2-[2-nitro-3-(phenylcarbonyl)phenyl]propanedioic acid

Systemtic Name: 2-[2-nitro-3-(phenylcarbonyl)phenyl]propanedioic acid Openeye Name: 2-(3-benzoyl-2-nitro-phenyl)propanedioic acid CAS Name: 2-(3-benzoyl-2-nitrophenyl)propanedioic acid IUPAC Name: 2-(3-benzoyl-2-nitrophenyl)propanedioic acid Traditional Name: 2-(3-benzoyl-2-nitro-phenyl)malonic acid Formula: C16H11NO7 MolecularWeight: 329.26104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)C(C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)C(C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO7/c18-14(9-5-2-1-3-6-9)11-8-4-7-10(13(11)17(23)24)12(15(19)20)16(21)22/h1-8,12H,(H,19,20)(H,21,22)